Information card for entry 4346867

Structure parameters

• Formula: C26 H28 Cl2 N6 O13 Ru
• Calculated formula: C26 H28 Cl2 N6 O13 Ru
• Title of publication: Single Site Isomeric Ru WOCs with an Electron-Withdrawing Group: Synthesis, Electrochemical Characterization, and Reactivity.
• Authors of publication: Mognon, Lorenzo; Benet-Buchholz, Jordi; Llobet, Antoni
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 24
• Pages of publication: 11948 - 11957
• a: 8.4167 ± 0.0006 Å
• b: 19.4697 ± 0.0012 Å
• c: 19.9959 ± 0.0014 Å
• α: 90°
• β: 101.366 ± 0.002°
• γ: 90°
• Cell volume: 3212.5 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0735
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1074
• Weighted residual factors for all reflections included in the refinement: 0.1208
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No